COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550246
Chemical Name: 2-(2-{[6-ethyl-6-methyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}ethyl)-1H-isoindole-1,3(2H)-dione
Smiles: CCC1(C)OCc2c(C1)c1c(SCCN3C(=O)c4c(C3=O)cccc4)nc(nc1s2)SC

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Molecular Weight: 485.65
Empirical Formula: C23H23N3O3S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.202
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 151
Number of rings: 5

     

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